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N-(3-((phenyl)ethynyl)cyclohex-2-en-1-yl)-4-methyl-N-(thiophen-3-ylethynyl)benzenesulfonamide
SpectraBase Compound ID D89U9jCsSbv
InChI InChI=1S/C27H23NO2S2/c1-22-10-14-27(15-11-22)32(29,30)28(18-16-25-17-19-31-21-25)26-9-5-8-24(20-26)13-12-23-6-3-2-4-7-23/h2-4,6-7,10-11,14-15,17,19-21,26H,5,8-9H2,1H3
InChIKey FWGNFESYZBJDME-UHFFFAOYSA-N
Mol Weight 457.61 g/mol
Molecular Formula C27H23NO2S2
Exact Mass 457.117021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iuyr6EXnEhi
Name N-(3-((phenyl)ethynyl)cyclohex-2-en-1-yl)-4-methyl-N-(thiophen-3-ylethynyl)benzenesulfonamide
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Formula C27H23NO2S2
InChI InChI=1S/C27H23NO2S2/c1-22-10-14-27(15-11-22)32(29,30)28(18-16-25-17-19-31-21-25)26-9-5-8-24(20-26)13-12-23-6-3-2-4-7-23/h2-4,6-7,10-11,14-15,17,19-21,26H,5,8-9H2,1H3
InChIKey FWGNFESYZBJDME-UHFFFAOYSA-N
Molecular Weight 457.606 g/mol
SMILES c1(ccc(cc1)C)S(N(C1C=C(CCC1)C#Cc1ccccc1)C#Cc1cscc1)(=O)=O
SPLASH splash10-0ue9-0917000000-03af0fc98e812fd51dc3
Source of Spectrum ASC-361-SM15-1k
Synonyms 4-Methyl-N-(3-(phenylethynyl)cyclohex-2-en-1-yl)-N-(thiophen-3-ylethynyl)benzenesulfonamide
Wiley ID 1813969